[2-[4-(3-acetamidopropyl)phenyl]-2-oxidanylidene-ethyl] 3-(4,7-dimethyl-2-oxidanylidene-chromen-3-yl)propanoate

Systemtic Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxidanylidene-ethyl] 3-(4,7-dimethyl-2-oxidanylidene-chromen-3-yl)propanoate Openeye Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxo-ethyl] 3-(4,7-dimethyl-2-oxo-chromen-3-yl)propanoate CAS Name: 3-(4,7-dimethyl-2-oxo-1-benzopyran-3-yl)propanoic acid [2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] 3-(4,7-dimethyl-2-oxochromen-3-yl)propanoate Traditional Name: 3-(2-keto-4,7-dimethyl-chromen-3-yl)propionic acid [2-[4-(3-acetamidopropyl)phenyl]-2-keto-ethyl] ester Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)OCC(=O)C3=CC=C(C=C3)CCCNC(=O)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)OCC(=O)C3=CC=C(C=C3)CCCNC(=O)C)C

InChI

InChI=1S/C27H29NO6/c1-17-6-11-22-18(2)23(27(32)34-25(22)15-17)12-13-26(31)33-16-24(30)21-9-7-20(8-10-21)5-4-14-28-19(3)29/h6-11,15H,4-5,12-14,16H2,1-3H3,(H,28,29)